1-(4-chlorophenyl)carbonyl-N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)carbonyl-N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]piperidine-3-carboxamide Openeye Name: 1-(4-chlorobenzoyl)-N-[2-(dimethylamino)-2-(2-thienyl)ethyl]piperidine-3-carboxamide CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-chlorobenzoyl)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-3-carboxamide Traditional Name: 1-(4-chlorobenzoyl)-N-[2-(dimethylamino)-2-(2-thienyl)ethyl]nipecotamide Formula: C21H26ClN3O2S MolecularWeight: 419.96804

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)Cl)C3=CC=CS3

Isomeric SMILES

CN(C)C(CNC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)Cl)C3=CC=CS3

InChI

InChI=1S/C21H26ClN3O2S/c1-24(2)18(19-6-4-12-28-19)13-23-20(26)16-5-3-11-25(14-16)21(27)15-7-9-17(22)10-8-15/h4,6-10,12,16,18H,3,5,11,13-14H2,1-2H3,(H,23,26)